propan-2-yl 3-[[1-(2-chloranylpyridin-3-yl)sulfonylpiperidin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[[1-(2-chloranylpyridin-3-yl)sulfonylpiperidin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[[1-[(2-chloro-3-pyridyl)sulfonyl]piperidine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 3-[[[1-[(2-chloro-3-pyridinyl)sulfonyl]-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[1-(2-chloropyridin-3-yl)sulfonylpiperidine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 3-[[1-[(2-chloro-3-pyridyl)sulfonyl]isonipecotoyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C23H28ClN3O5S MolecularWeight: 494.00352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C23H28ClN3O5S/c1-16(2)32-21(28)15-19(17-7-4-3-5-8-17)26-23(29)18-10-13-27(14-11-18)33(30,31)20-9-6-12-25-22(20)24/h3-9,12,16,18-19H,10-11,13-15H2,1-2H3,(H,26,29)